기본 정보
- CAS
59938-06-6- 표준 SMILES
CCO/C=C/C(=O)C(F)(F)F- InChIKey
YKYIFUROKBDHCY-ONEGZZNKSA-N- 분자식
- C6H7F3O2
- 평균 분자량
- 168.11 g/mol
- 단동위원소 질량
- 168.03981412
이름 및 식별자
- 우선 이름
- (3E)-4-Ethoxy-1,1,1-trifluoro-3-buten-2-one
- IUPAC
- (E)-4-ethoxy-1,1,1-trifluorobut-3-en-2-one
- 현지명
- 1-에톡시-3-트리플루오로메틸-1,3-부타디엔
- 영어명
- 1-Ethoxy-3-trifluoromethyl-1,3-butadiene
- 분자식
- C6H7F3O2
- 분자량
- 168.11
이름 및 동의어
(3E)-4-ethoxy-1,1,1-trifluorobut-3-en-2-one3-Buten-2-one, 4-ethoxy-1,1,1-trifluoro-, (3E)-DTXSID801033246(3E)-4-ethoxy-1,1,1-trifluoro-3-buten-2-one(e)-4-ethoxy-1,1,1-trifluoro-3-buten-2-one (stabilized with bht)RefChem:400697DTXCID60371622475-900-3858-371-7(E)-4-ethoxy-1,1,1-trifluorobut-3-en-2-one59938-06-64-ethoxy-1,1,1-trifluorobut-3-en-2-one
이름 더 보기
1-에톡시-3-트리플루오로메틸-1,3-부타디엔2-Trifluoroacetyl vinyl ether4-ethoxy-1,1,1-trifluoro-3-butene-2-one1-Ethoxy-3-trifluoromethyl-1,3-butadienetrans-4-Ethoxy-1,1,1-trifluoro-3-butene-2-one(E)-1-ethoxy-3-trifluoromethyl-1,3-butyldiene(3E)-4-ethoxy-1,1,1-trifluorobut-3-en-2-one, E(1E)-1-Ethoxy-3-(trifluoromethyl)-1,3-butadiene(3E)-4-ethoxy-1,1,1-trifluorobut-3-en-2-one - [E10888]
ETFBO(E)-4-ethoxy-1,1,1-trifluoro-3-buten-2-oneCS-01980184-Ethoxy-1,1,1-trifluoro-3-buten-2-one, contains 0.5% BHT as stabilizer, technical grade(3Z)-4-ethoxy-1,1,1-trifluorobut-3-en-2-one2-(Trifluoroacetyl)vinyl Ethyl Ether; 2-Ethoxyvinyl Trifluoromethyl Ketone; 4-Ethoxy-1,1,1-trifluoro-3-buten-2-one(e)-4-ethoxy-1,1,1-trifluoro-but-3-en-2-oneSCHEMBL71609
데이터베이스 식별자
- CAS
59938-06-6- PubChem CID
- 5709222
- DTXSID
DTXSID801033246- UNII
- 294SL62B6H
- EC Number
- 475-900-3、858-371-7
- Nikkaji
- J371.193E、J385.517A
물성
구조 계산 물성
- XLogP
- 1.6
- 극성 표면적
- 26.3 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 11
- 형식 전하
- 0
- 복잡도
- 160
실험 및 물리화학적 성질
PFASPFAS -> PFAS identified in REACH Regulation EC No. 1272/2008
물리화학적 성질
- 끓는 점
- 105 ℃ · 105℃
- 밀도
- 1.191 · 1.191
- 증기압
- 3.02 hPa · 3.02hPa at 20℃
- 굴절률
- 1.4 · 1.40
- 인화점
- 18 ℃ · 18℃
- 저장 조건
- 2 · Storage temp. 2-8°C
- 물리적 상태
- 투명한 액체
- 색상
- Colorless to Light orange to Yellow
- EPA
- 3 · 3-Buten-2-one, 4-ethoxy-1,1,1-trifluoro-, (3E)- (59938-06-6)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P272, P273, P280, P284, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P320, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Danger
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
유해성 정보
Regulatory Information
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Status: Active Update: 10-12-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/15638
Hazard Classes and Categories
Flam. Liq. 3 (100%)
Flam. Liq. 3 (100%)
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
General Manufacturing Information3-Buten-2-one, 4-ethoxy-1,1,1-trifluoro-, (3E)-: ACTIVE
상·하류 제품 정보
하류 제품
공급사82 곳
山东玖玥生物科技有限公司15553333686 · [email protected]
上海利卡斯实业有限公司19821976800 · [email protected]
苏州道澜生物医药科技有限公司15952404857 · [email protected]
合肥曼奇诺生物医药技术有限公司19719236623 · [email protected]
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